Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | SCN1A | P35498 | 2/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11042479 | 1.00 | HTT (0.46) | HTTALDH1A1HTR7MAPTNAAA | |
| SCHEMBL11102882 | 0.93 | HTT (0.46) | HTTALDH1A1HTR7MAPTNAAA | |
| SCHEMBL11102613 | 0.91 | ALDH1A1 (0.45) | HTTALDH1A1HTR7MAPTNAAA | |
| SCHEMBL11099288 | 0.91 | ALDH1A1 (0.45) | HTTALDH1A1HTR7MAPTNAAA | |
| SCHEMBL11098131 | 0.91 | ALDH1A1 (0.45) | HTTALDH1A1HTR7MAPTNAAA | |
| SCHEMBL10799986 | 0.91 | CYP2C9 (0.44) | HTTALDH1A1MAPTSCN1ASCN2A | |
| SCHEMBL6696396 | 0.91 | CYP2C9 (0.44) | HTTALDH1A1MAPTSCN1ASCN2A | |
| SCHEMBL5835906 | 0.91 | CYP2C9 (0.44) | HTTALDH1A1MAPTSCN1ASCN2A | |
| SCHEMBL6696392 | 0.91 | CYP2C9 (0.44) | HTTALDH1A1MAPTSCN1ASCN2A | |
| SCHEMBL12199928 | 0.90 | HTT (0.46) | HTTALDH1A1MAPTNAAASCN1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57054148-A | — | — | None | — | — | JP | disclosed |
| US-4487954-A | LIQUID CRYSTALS | CHISSO CORPORATION (JP) | 1984-12-11 | — | — | US | disclosed |
| JP-S5754148-A | 4-HALOGENOBENZOIC ACID TRANS-4'(TRANS-4\"-ALKYLCYCLOHEXYL)CYCLOHEXYL ESTER | CHISSO CORP | 1982-03-31 | — | — | JP | disclosed |